KEGG   DRUG: TimoprazoleHelp
Entry
D05900                      Drug                                   

Name
Timoprazole (INN)
Formula
C13H11N3OS
Exact mass
257.0623
Mol weight
257.3109
Structure
Mol fileKCF fileDB search
Class
Gastrointestinal agent
 DG01646  Proton pump inhibitor (PPI)
 DG01975  Agents for peptic ulcer
  DG01646  Proton pump inhibitor (PPI)
Efficacy
Antisecretory (gastric acid), Proton pump inhibitor
Comment
Benzimidazole derivative
Target
ATP4 [HSA:495 496] [KO:K01542 K01543]
  Pathway
hsa04966  Collecting duct acid secretion
hsa04971  Gastric acid secretion
Interaction
Drug interaction
Structure map
map07038  Antiulcer drugs
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   ATPase
    ATP4
     D05900  Timoprazole (INN)
BRITE hierarchy
Other DBs
CAS: 57237-97-5
PubChem: 17398308
ChEMBL: CHEMBL9861
LigandBox: D05900
NIKKAJI: J11.738B
LinkDB All DBs
KCF data Show

ATOM        18
            1   C8x C    11.5500  -19.2500
            2   C8x C    11.5500  -20.6500
            3   C8x C    12.7624  -21.3500
            4   C8y C    13.9749  -20.6500
            5   C8y C    13.9749  -19.2500
            6   C8x C    12.7624  -18.5500
            7   N5x N    15.3064  -21.0826
            8   C8y C    16.1293  -19.9500
            9   N4x N    15.3064  -18.8174
            10  S4a S    17.5000  -19.9500
            11  C1b C    18.2000  -21.1624
            12  O3c O    18.2000  -18.7376
            13  C8y C    19.5998  -21.1624
            14  C8x C    20.2903  -22.3580
            15  C8x C    21.6903  -22.3578
            16  C8x C    22.3901  -21.1453
            17  C8x C    21.6997  -19.9498
            18  N5x N    20.2997  -19.9499
BOND        20
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    5   9 1
            11    8  10 1
            12   10  11 1
            13   10  12 2
            14   11  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   13  18 1

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